# generated using pymatgen data_Nd3Sm9(Si7Br3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.05035088 _cell_length_b 11.56808541 _cell_length_c 16.38662212 _cell_angle_alpha 90.13184104 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3Sm9(Si7Br3)2 _chemical_formula_sum 'Nd3 Sm9 Si14 Br6' _cell_volume 767.78995057 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Nd Nd0 1 0.00000000 0.93623632 0.62068097 1.0 Nd Nd1 1 0.50000000 0.06366801 0.11938378 1.0 Nd Nd2 1 0.00000000 0.93588469 0.38007054 1.0 Sm Sm3 1 0.50000000 0.34398581 0.49980056 1.0 Sm Sm4 1 0.00000000 0.65646641 0.00002626 1.0 Sm Sm5 1 0.50000000 0.35975699 0.75743091 1.0 Sm Sm6 1 0.00000000 0.64047024 0.74297038 1.0 Sm Sm7 1 0.50000000 0.35979258 0.24193650 1.0 Sm Sm8 1 0.00000000 0.63972773 0.25756009 1.0 Sm Sm9 1 0.50000000 0.06557176 0.88043642 1.0 Sm Sm10 1 0.50000000 0.35750876 0.99959048 1.0 Sm Sm11 1 0.00000000 0.64188506 0.50019404 1.0 Si Si12 1 0.00000000 0.15090118 0.99911294 1.0 Si Si13 1 0.50000000 0.84797996 0.50040490 1.0 Si Si14 1 0.50000000 0.56959243 0.87611327 1.0 Si Si15 1 0.00000000 0.43033813 0.62408390 1.0 Si Si16 1 0.50000000 0.56967245 0.12373288 1.0 Si Si17 1 0.00000000 0.42993181 0.37580763 1.0 Si Si18 1 0.00000000 0.25324193 0.87265458 1.0 Si Si19 1 0.50000000 0.74585412 0.62721575 1.0 Si Si20 1 0.00000000 0.25394716 0.12608952 1.0 Si Si21 1 0.50000000 0.74543176 0.37347746 1.0 Si Si22 1 0.00000000 0.45915676 0.87650081 1.0 Si Si23 1 0.50000000 0.54061968 0.62366225 1.0 Si Si24 1 0.50000000 0.54025727 0.37659216 1.0 Si Si25 1 0.00000000 0.45928553 0.12302165 1.0 Br Br26 1 0.50000000 0.11068821 0.69416530 1.0 Br Br27 1 0.00000000 0.89153198 0.80875176 1.0 Br Br28 1 0.00000000 0.14200008 0.50041731 1.0 Br Br29 1 0.50000000 0.85920669 0.99851908 1.0 Br Br30 1 0.50000000 0.11128548 0.30720022 1.0 Br Br31 1 0.00000000 0.88812202 0.19239571 1.0